3-[2-oxidanylidene-2-(4-pyridin-4-ylpiperazin-1-yl)ethoxy]benzenecarboximidamide

Systemtic Name: 3-[2-oxidanylidene-2-(4-pyridin-4-ylpiperazin-1-yl)ethoxy]benzenecarboximidamide Openeye Name: 3-[2-oxo-2-[4-(4-pyridyl)piperazin-1-yl]ethoxy]benzamidine CAS Name: 3-[2-oxo-2-(4-pyridin-4-yl-1-piperazinyl)ethoxy]benzenecarboximidamide IUPAC Name: 3-[2-oxo-2-(4-pyridin-4-ylpiperazin-1-yl)ethoxy]benzenecarboximidamide Traditional Name: 3-[2-keto-2-[4-(4-pyridyl)piperazino]ethoxy]benzamidine Formula: C18H21N5O2 MolecularWeight: 339.39164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)COC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)COC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C18H21N5O2/c19-18(20)14-2-1-3-16(12-14)25-13-17(24)23-10-8-22(9-11-23)15-4-6-21-7-5-15/h1-7,12H,8-11,13H2,(H3,19,20)